1,4-bis(chloranyl)-N-[1-(4-methylpiperazin-1-yl)carbonylcyclopentyl]isoquinoline-7-sulfonamide

Systemtic Name: 1,4-bis(chloranyl)-N-[1-(4-methylpiperazin-1-yl)carbonylcyclopentyl]isoquinoline-7-sulfonamide Openeye Name: 1,4-dichloro-N-[1-(4-methylpiperazine-1-carbonyl)cyclopentyl]isoquinoline-7-sulfonamide CAS Name: 1,4-dichloro-N-[1-[(4-methyl-1-piperazinyl)-oxomethyl]cyclopentyl]-7-isoquinolinesulfonamide IUPAC Name: 1,4-dichloro-N-[1-(4-methylpiperazine-1-carbonyl)cyclopentyl]isoquinoline-7-sulfonamide Traditional Name: 1,4-dichloro-N-[1-(4-methylpiperazine-1-carbonyl)cyclopentyl]isoquinoline-7-sulfonamide Formula: C20H24Cl2N4O3S MolecularWeight: 471.40056

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(=O)C2(CCCC2)NS(=O)(=O)C3=CC4=C(C=C3)C(=CN=C4Cl)Cl

Isomeric SMILES

CN1CCN(CC1)C(=O)C2(CCCC2)NS(=O)(=O)C3=CC4=C(C=C3)C(=CN=C4Cl)Cl

InChI

InChI=1S/C20H24Cl2N4O3S/c1-25-8-10-26(11-9-25)19(27)20(6-2-3-7-20)24-30(28,29)14-4-5-15-16(12-14)18(22)23-13-17(15)21/h4-5,12-13,24H,2-3,6-11H2,1H3